Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: 4H-1,2,4-Triazole-3-thiol, 5-(p-chlorophenyl)-4-methyl-
RN: 29527-27-3
InChIKey: HAWRMYDVPCGDJW-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C9-H8-Cl-N3-S

Molecular Weight

  • 225.702
 
* denotes mobile formatted website

Links to Resources

NLM Resources (File Locators)

Other Resources (Internet Locators)


Search for this InChIKey on the Web

Names and Synonyms

Synonym

  • 5-(p-Chlorophenyl)-4-methyl-4H-1,2,4-triazole-3-thiol

Systematic Name

  • 4H-1,2,4-Triazole-3-thiol, 5-(p-chlorophenyl)-4-methyl-

Registry Numbers

CAS Registry Number

  • 29527-27-3

System Generated Number

  • 0029527273

Structure Descriptors

InChI

1S/C9H8ClN3S/c1-13-8(11-12-9(13)14)6-2-4-7(10)5-3-6/h2-5H,1H3,(H,12,14)

InChIKey

HAWRMYDVPCGDJW-UHFFFAOYSA-N

Smiles

n1[nH]c(n(c1c1ccc(cc1)Cl)C)=S

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal > 800mg/kg (800mg/kg)   Journal of Medicinal Chemistry. Vol. 31, Pg. 1253, 1988.